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7JP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F33C30sing1.35Å1.35Å
C31C30doub1.39Å1.38ÅAromatic
C31C32sing1.38Å1.38ÅAromatic
C30C29sing1.39Å1.40ÅAromatic
C32C27doub1.39Å1.39ÅAromatic
C29C28doub1.38Å1.38ÅAromatic
C27C28sing1.39Å1.38ÅAromatic
C27C2sing1.48Å1.46Å
C2C1doub1.39Å1.39ÅAromatic
C2C3sing1.40Å1.42ÅAromatic
C1C6sing1.39Å1.42ÅAromatic
C3C4doub1.38Å1.41ÅAromatic
C14C15sing1.53Å1.54Å
C14C13sing1.53Å1.53Å
O12C11doub1.22Å1.23Å
C15C16sing1.53Å1.52Å
C6C11sing1.47Å1.45Å
C6C7doub1.41Å1.43ÅAromatic
C11N10sing1.35Å1.40Å
C4C7sing1.40Å1.40ÅAromatic
C4O5sing1.36Å1.35Å
C7N8sing1.36Å1.39Å
N10C13sing1.47Å1.46Å
N10C9sing1.36Å1.39Å
C17C16sing1.53Å1.59Å
C17N18sing1.47Å1.43Å
N8C9doub1.30Å1.30Å
C19N18sing1.37Å1.41ÅAromatic
C19C20doub1.34Å1.41ÅAromatic
N18C21sing1.37Å1.39ÅAromatic
C20C22sing1.46Å1.45ÅAromatic
C21C26doub1.39Å1.41ÅAromatic
C21C22sing1.41Å1.45ÅAromatic
C26C25sing1.38Å1.38ÅAromatic
C22C23doub1.39Å1.38ÅAromatic
C25N24doub1.32Å1.34ÅAromatic
C23N24sing1.32Å1.33ÅAromatic
C13H1sing1.09Å1.10Å
C13H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C17H5sing1.09Å1.10Å
C17H6sing1.09Å1.10Å
C20H7sing1.08Å1.08Å
C26H8sing1.08Å1.08Å
C28H9sing1.08Å1.08Å
C1H10sing1.08Å1.08Å
C3H11sing1.08Å1.08Å
O5H12sing0.97Å0.95Å
C9H13sing1.08Å1.08Å
C14H14sing1.09Å1.10Å
C14H15sing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C16H17sing1.09Å1.10Å
C19H18sing1.08Å1.08Å
C23H19sing1.08Å1.08Å
C25H20sing1.08Å1.08Å
C29H21sing1.08Å1.08Å
C31H22sing1.08Å1.08Å
C32H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F33C30C31120.0°119.9°
F33C30C29116.9°119.9°
C30C31C32119.6°120.1°
C31C30C29123.1°120.2°
C30C31H22120.2°120.0°
C31C32C27119.1°119.9°
C32C31H22120.2°119.9°
C31C32H23120.4°120.1°
C30C29C28114.9°120.1°
C30C29H21122.6°119.9°
C32C27C28119.6°119.8°
C32C27C2119.0°120.1°
C27C32H23120.5°120.1°
C29C28C27123.6°119.9°
C29C28H9118.2°120.0°
C28C29H21122.5°120.0°
C28C27C2121.4°120.1°
C27C28H9118.2°120.1°
C27C2C1120.4°119.8°
C27C2C3119.9°119.8°
C1C2C3119.7°120.4°
C2C1C6120.9°119.5°
C2C1H10119.6°120.3°
C2C3C4120.6°120.7°
C2C3H11119.7°119.7°
C1C6C11122.9°121.8°
C1C6C7119.0°120.2°
C6C1H10119.6°120.2°
C3C4C7119.7°119.7°
C3C4O5121.8°120.1°
C4C3H11119.7°119.7°
C15C14C13114.8°109.5°
C14C15C16111.9°109.5°
C14C15H3108.8°109.5°
C14C15H4108.9°109.4°
C15C14H14108.1°109.5°
C15C14H15108.1°109.4°
C14C13N10109.1°109.5°
C14C13H1109.6°109.5°
C14C13H2109.6°109.5°
C13C14H14108.1°109.5°
C13C14H15108.1°109.5°
O12C11C6122.2°121.3°
O12C11N10120.1°121.3°
C15C16C17111.6°109.4°
C16C15H3108.9°109.5°
C16C15H4108.8°109.5°
C15C16H16108.9°109.5°
C15C16H17108.9°109.5°
C11C6C7118.1°118.0°
C6C11N10117.6°117.4°
C6C7C4120.1°119.5°
C6C7N8121.4°119.0°
C11N10C13119.1°119.7°
C11N10C9118.7°120.6°
C7C4O5118.5°120.2°
C4C7N8118.5°121.5°
C4O5H12109.5°114.0°
C7N8C9117.7°121.7°
C13N10C9122.1°119.7°
N10C13H1109.6°109.4°
N10C13H2109.6°109.5°
N10C9N8126.3°123.3°
N10C9H13116.9°118.3°
C16C17N18106.9°109.5°
C16C17H5110.1°109.5°
C16C17H6110.1°109.5°
C17C16H16108.9°109.4°
C17C16H17108.9°109.5°
C17N18C19125.2°125.0°
C17N18C21125.6°125.0°
N18C17H5110.1°109.4°
N18C17H6110.1°109.4°
N8C9H13116.8°118.4°
N18C19C20108.3°110.0°
C19N18C21109.1°110.0°
N18C19H18125.9°125.0°
C19C20C22108.4°106.9°
C19C20H7125.8°126.5°
C20C19H18125.8°125.0°
N18C21C26129.7°134.7°
N18C21C22108.8°107.2°
C20C22C21105.4°106.0°
C20C22C23136.5°134.9°
C22C20H7125.8°126.6°
C26C21C22121.5°118.1°
C21C26C25112.5°118.9°
C21C26H8123.8°120.5°
C21C22C23118.0°119.1°
C26C25N24128.1°121.5°
C25C26H8123.8°120.6°
C26C25H20115.9°119.2°
C22C23N24121.4°120.1°
C22C23H19119.3°119.9°
C25N24C23118.6°122.2°
N24C25H20116.0°119.3°
N24C23H19119.3°119.9°
H1C13H2109.4°109.5°
H3C15H4109.5°109.5°
H5C17H6109.5°109.5°
H14C14H15109.5°109.4°
H16C16H17109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F33C30C31C29178.3°180.0°
F33C30C31C32179.2°179.7°
F33C30C29C28179.0°180.0°
F33C30C29H211.0°0.0°
F33C30C31H220.8°0.0°
C30C31C32H22180.0°179.7°
C30C31C32C270.4°0.3°
C31C30C29C280.7°0.1°
C31C30C29H21179.3°180.0°
C30C31C32H23179.6°180.0°
C32C31C30C290.9°0.3°
C31C32C27H23180.0°179.7°
C31C32C27C281.8°0.0°
C31C32C27C2178.6°180.0°
C30C29C28H21180.0°180.0°
C30C29C28C270.8°0.3°
C30C29C28H9179.2°180.0°
C29C30C31H22179.1°180.0°
C32C27C28C292.1°0.3°
C32C27C28C2179.6°180.0°
C32C27C2C135.5°0.0°
C32C27C2C3143.5°179.3°
C32C27C28H9177.9°180.0°
C27C32C31H22179.6°180.0°
C29C28C27H9180.0°179.7°
C29C28C27C2178.3°179.7°
C28C27C2C1144.2°180.0°
C28C27C2C336.9°0.7°
C27C28C29H21179.2°179.7°
C28C27C32H23178.2°179.7°
C27C2C1C3178.9°179.3°
C27C2C1C6179.0°180.0°
C27C2C3C4178.8°179.8°
C2C27C28H91.7°0.0°
C27C2C1H100.9°0.4°
C27C2C3H111.2°0.3°
C2C27C32H231.4°0.3°
C2C1C6H10180.0°179.6°
C1C2C3C40.1°0.5°
C2C1C6C11178.9°179.5°
C2C1C6C70.0°0.5°
C1C2C3H11179.9°179.6°
C3C2C1C60.1°0.7°
C2C3C4H11180.0°179.9°
C2C3C4C70.4°0.0°
C2C3C4O5179.6°179.7°
C3C2C1H10179.8°179.7°
C1C6C11O120.6°0.0°
C1C6C11C7178.9°180.0°
C1C6C11N10178.0°180.0°
C1C6C7C40.3°0.0°
C1C6C7N8177.8°180.0°
C3C4C7C60.5°0.3°
C3C4C7O5179.2°179.8°
C3C4C7N8177.6°179.8°
C3C4O5H12180.0°90.3°
C15C14C13H14120.8°120.0°
C15C14C13H15120.8°120.0°
C14C15C16H3120.3°120.0°
C14C15C16H4120.4°120.0°
C15C14C13N10168.2°180.0°
C14C15C16C17169.5°180.0°
C15C14C13H148.2°60.0°
C15C14C13H271.9°60.0°
C14C15H3H4118.9°120.0°
C15C14H14H15117.6°119.9°
C14C15C16H1649.1°60.0°
C14C15C16H1770.2°60.0°
C13C14C15C1657.0°180.0°
C14C13N10C1179.6°90.0°
C14C13N10H1120.0°120.0°
C14C13N10H2120.0°120.0°
C14C13N10C9104.7°90.1°
C14C13H1H2120.1°120.0°
C13C14C15H363.4°60.0°
C13C14C15H4177.4°60.0°
C13C14H14H15117.5°120.0°
O12C11C6N10177.4°180.0°
O12C11C6C7179.6°180.0°
O12C11N10C132.5°0.1°
O12C11N10C9178.3°180.0°
C15C16C17H16120.4°120.0°
C15C16C17H17120.3°120.0°
C15C16C17N18163.7°180.0°
C16C15H3H4118.9°120.0°
C15C16C17H576.7°60.1°
C15C16C17H644.1°60.0°
C16C15C14H1463.8°59.9°
C16C15C14H15177.8°60.0°
C15C16H16H17119.0°120.0°
C11C6C7C4179.3°180.0°
C11C6C7N81.2°0.0°
C6C11N10C13179.9°180.0°
C6C11N10C94.2°0.0°
C11C6C1H101.2°0.0°
C7C6C11N103.1°0.0°
C6C7C4N8178.1°180.0°
C6C7C4O5179.7°180.0°
C6C7N8C94.3°0.0°
C7C6C1H10179.9°180.0°
C11N10C13C9175.7°179.9°
C11N10C9N81.1°0.0°
C11N10C13H140.4°29.9°
C11N10C13H2160.5°150.0°
C11N10C9H13178.9°179.9°
C4C7N8C9177.6°180.0°
C7C4C3H11179.6°179.9°
C7C4O5H120.8°90.0°
O5C4C7N81.6°0.0°
O5C4C3H110.4°0.2°
C7N8C9N103.2°0.0°
C7N8C9H13176.7°180.0°
C13N10C9N8176.9°180.0°
N10C13H1H2120.2°120.0°
C13N10C9H133.2°0.0°
N10C13C14H1471.1°60.0°
N10C13C14H1547.4°60.0°
N10C9N8H13180.0°180.0°
C9N10C13H1135.3°150.0°
C9N10C13H215.2°30.0°
C16C17N18H5119.6°120.0°
C16C17N18H6119.6°120.0°
C16C17N18C1960.7°95.0°
C16C17N18C21122.2°85.0°
C17C16C15H370.2°60.0°
C17C16C15H449.1°60.0°
C16C17H5H6121.2°120.1°
C17C16H16H17119.0°120.0°
C17N18C19C21177.5°179.9°
C17N18C19C20177.3°179.7°
C17N18C21C261.3°0.0°
C17N18C21C22176.9°179.6°
N18C17H5H6121.2°119.9°
N18C17C16H1643.4°60.0°
N18C17C16H1776.0°60.0°
C17N18C19H182.7°0.1°
N18C19C20H18180.0°179.8°
N18C19C20C220.2°0.0°
C19N18C21C26178.8°180.0°
C19N18C21C220.7°0.4°
C19N18C17H5179.7°145.1°
C19N18C17H658.9°25.1°
N18C19C20H7179.8°179.8°
C20C19N18C210.3°0.2°
C19C20C22H7180.0°179.8°
C19C20C22C210.6°0.2°
C19C20C22C23176.0°179.8°
N18C21C22C200.8°0.3°
N18C21C26C22177.9°179.6°
N18C21C26C25177.4°179.6°
N18C21C22C23176.6°179.7°
C21N18C17H52.6°35.0°
C21N18C17H6118.2°155.0°
N18C21C26H82.6°0.4°
C21N18C19H18179.7°180.0°
C20C22C21C26179.1°180.0°
C20C22C21C23177.3°180.0°
C20C22C23N24178.1°180.0°
C22C20C19H18179.8°179.8°
C20C22C23H191.9°0.1°
C21C26C25H8180.0°180.0°
C26C21C22C231.7°0.0°
C21C26C25N240.9°0.0°
C21C26C25H20179.2°180.0°
C22C21C26C250.5°0.0°
C21C22C23N241.8°0.0°
C21C22C20H7179.4°180.0°
C22C21C26H8179.5°180.0°
C21C22C23H19178.2°179.9°
C26C25N24H20180.0°180.0°
C26C25N24C230.8°0.0°
C22C23N24C250.7°0.0°
C22C23N24H19180.0°180.0°
C23C22C20H74.0°0.0°
N24C25C26H8179.2°180.0°
C25N24C23H19179.3°180.0°
C23N24C25H20179.2°180.0°
H1C13C14H14169.0°180.0°
H1C13C14H1572.6°60.0°
H2C13C14H1448.9°60.0°
H2C13C14H15167.3°180.0°
H3C15C14H14175.9°180.0°
H3C15C14H1557.4°60.0°
H3C15C16H16169.5°180.0°
H3C15C16H1750.1°60.0°
H4C15C14H1456.6°60.1°
H4C15C14H1561.9°NaN°
H4C15C16H1671.3°60.0°
H4C15C16H17169.4°180.0°
H5C17C16H16163.0°180.0°
H5C17C16H1743.7°59.9°
H6C17C16H1676.2°60.0°
H6C17C16H17164.5°180.0°
H7C20C19H180.2°0.0°
H8C26C25H200.8°0.0°
H9C28C29H210.8°0.0°
H22C31C32H230.4°0.3°

226262

PDB entries from 2024-10-16

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